SCHEMBL5525830

SCHEMBL5525830

CCCC(=O)N(Cc1ccc(-c2ccccc2S(=O)(=O)N(CC2CC2)c2onc(C)c2C)cc1)[C@H](C(N)=O)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.44
EDNRA P25101 5/20 0.38
EDNRB P24530 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRK1 P41145 1/20 0.37
LTB4R2 Q9NPC1 2/20 0.37
ABCB11 O95342 1/20 0.37
GP6 Q9HCN6 1/20 0.37
OXTR P30559 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5520710 0.89 AGTR1 (0.45) AGTR1EDNRAEDNRBOPRM1OPRK1
SCHEMBL4775333 0.84 AGTR1 (0.51) AGTR1EDNRAEDNRBLTB4R2ABCB11
SCHEMBL4771875 0.77 EDNRA (0.59) AGTR1EDNRAEDNRB
SCHEMBL5525827 0.76 EDNRA (0.54) EDNRAEDNRB
SCHEMBL4776095 0.74 AGTR1 (0.51) AGTR1EDNRALTB4R2ABCB11GP6
SCHEMBL5529478 0.74 AGTR1 (0.55) AGTR1OPRM1OPRK1LTB4R2ABCB11
SCHEMBL5525953 0.73 AGTR1 (0.54) AGTR1EDNRAOPRM1OPRK1LTB4R2
SCHEMBL4771630 0.73 EDNRA (0.59) EDNRAEDNRB
SCHEMBL4766229 0.73 EDNRA (0.59) EDNRAEDNRB
SCHEMBL5530777 0.72 EDNRA (0.59) AGTR1EDNRAEDNRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1741713-A2 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists Bristol-Myers Squibb Company (US) 2007-01-10 EP claimed
US-20040127515-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists PHARMACOPEIA, LLC 2004-07-01 US claimed
US-20020143024-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists PHARMACOPEIA, LLC 2002-10-03 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040127515-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists EDNRB, AGTR2, EDNRA AGTR1 4/4885EDNRA 3/4885EDNRB 1/4885
US-20020143024-A1 Biphenyl sulfonamides as dual angiotensin endothelin receptor antagonists EDNRB, AGTR2, EDNRA AGTR1 4/4885EDNRA 3/4885EDNRB 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.